SCHEMBL11010339

SCHEMBL11010339

COC(=O)[C@H](Cc1ccc(C(=O)[C@@H](N)CC(=O)O)cc1)NC=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 7/20 0.41
ANPEP P15144 1/20 0.40
ERAP2 Q6P179 5/20 0.39
ERAP1 Q9NZ08 4/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
PPARG P37231 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11020769 1.00 LNPEP (0.41) LNPEPANPEPERAP2ERAP1GAA
SCHEMBL10359243 0.88 TPH1 (0.39) L3MBTL1
SCHEMBL8214893 0.83 ALDH1A1 (0.44) LNPEPERAP2ERAP1ALDH1A1
SCHEMBL27308574 0.79 OPRK1 (0.40) ANPEPATMALDH1A1THRBCYP2C9
SCHEMBL27328776 0.79 OPRK1 (0.40) ANPEPATMALDH1A1THRBCYP2C9
SCHEMBL6572040 0.78 LNPEP (0.45) LNPEPANPEPATMALDH1A1THRB
SCHEMBL11549702 0.78 LNPEP (0.45) LNPEPANPEPATMALDH1A1THRB
SCHEMBL3499885 0.78 ATM (0.58) ANPEPATMALDH1A1LMNAGLA
SCHEMBL27925079 0.78 ATM (0.58) ANPEPATMALDH1A1LMNAGLA
SCHEMBL1274700 0.78 ATM (0.58) ANPEPATMALDH1A1LMNAGLA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0132856-A2 Process for preparing alpha-L-aspartyl-L-phenylalanine methyl ester DE-BI DERIVATI BIOLOGICI INTERNATIONAL S.p.A. (IT) 1985-02-13 EP claimed
EP-0149263-A2 Process for preparing alpha-L-aspartyl-L-phenylalanine methyl ester DE-BI DERIVATI BIOLOGICI INTERNATIONAL S.p.A. (IT) 1985-07-24 EP disclosed
EP-0132856-A2 Process for preparing alpha-L-aspartyl-L-phenylalanine methyl ester DE-BI DERIVATI BIOLOGICI INTERNATIONAL S.p.A. (IT) 1985-02-13 EP disclosed
EP-0058063-B1 PROCESS FOR REMOVING AN N-FORMYL GROUP AJINOMOTO CO., INC. (JP) 1984-05-23 EP disclosed